[4-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxidanylidene-1H-quinolin-3-yl] ethanoate

Systemtic Name: [4-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxidanylidene-1H-quinolin-3-yl] ethanoate Openeye Name: [4-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxo-1H-quinolin-3-yl] acetate CAS Name: acetic acid [4-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxo-1H-quinolin-3-yl] ester IUPAC Name: [4-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxo-1H-quinolin-3-yl] acetate Traditional Name: acetic acid [4-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-2-keto-7-nitro-1H-quinolin-3-yl] ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCOC1=C(C(=O)NC2=C1C=CC(=C2)[N+](=O)[O-])OC(=O)C)C)C

Isomeric SMILES

CC(=CCC/C(=C\COC1=C(C(=O)NC2=C1C=CC(=C2)[N+](=O)[O-])OC(=O)C)/C)C

InChI

InChI=1S/C21H24N2O6/c1-13(2)6-5-7-14(3)10-11-28-19-17-9-8-16(23(26)27)12-18(17)22-21(25)20(19)29-15(4)24/h6,8-10,12H,5,7,11H2,1-4H3,(H,22,25)/b14-10-